4-ethanoyl-5-(4-fluorophenyl)-1-(2-piperazine-1,4-diium-1-ylethyl)pyrrolidine-2,3-dione

Systemtic Name: 4-ethanoyl-5-(4-fluorophenyl)-1-(2-piperazine-1,4-diium-1-ylethyl)pyrrolidine-2,3-dione Openeye Name: 4-acetyl-5-(4-fluorophenyl)-1-(2-piperazine-1,4-diium-1-ylethyl)pyrrolidine-2,3-dione CAS Name: 4-acetyl-5-(4-fluorophenyl)-1-[2-(1-piperazine-1,4-diiumyl)ethyl]pyrrolidine-2,3-dione IUPAC Name: 4-acetyl-5-(4-fluorophenyl)-1-(2-piperazine-1,4-diium-1-ylethyl)pyrrolidine-2,3-dione Traditional Name: 4-acetyl-5-(4-fluorophenyl)-1-(2-piperazine-1,4-diium-1-ylethyl)pyrrolidine-2,3-quinone Formula: C18H24FN3O3+2 MolecularWeight: 349.399863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(N(C(=O)C1=O)CC[NH+]2CC[NH2+]CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)C1C(N(C(=O)C1=O)CC[NH+]2CC[NH2+]CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3O3/c1-12(23)15-16(13-2-4-14(19)5-3-13)22(18(25)17(15)24)11-10-21-8-6-20-7-9-21/h2-5,15-16,20H,6-11H2,1H3/p+2